Inorganic Solid Phases

(1-x)BiFeO3-xSrTiO3, x= 0.2 (Sr0.5Ti0.5Fe0.5Bi0.5O3 rhom, T = 700 K) Crystal Structure

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General Information

  • Phase Label(s): Sr0.5Ti0.5Fe0.5Bi0.5O3 rhom
  • Structure Class(es): –
  • Classification by Properties: antiferromagnet AFM, ferroelectric FE, ferromagnet FM (?), hard magnet, multife
  • Mineral Name(s): –
  • Pearson Symbol: hR30
  • Space Group: 161
  • Phase Prototype: LiNbO3
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Australia, Lucas Heights, Australian Nuclear Science and Technology Organisation (determination of structural parameters), neutrons; λ = 0.1622 nm (determination of cell and structural parameters), T = 700 K (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; composition dependence studied; temperature dependence studied, Rietveld refinement, wRP = 0.0157
  • Sample Detail(s): sample prepared from Bi2O3, Fe2O3 (hematite), TiO2, SrCO3, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Sr0.2Ti0.2Fe0.8Bi0.8O3
  • Alphabetic Formula: Bi0.8Fe0.8O3Sr0.2Ti0.2
  • Published Formula: (1-x)BiFeO3-xSrTiO3, x= 0.2
  • Refined Formula: Bi0.80Fe0.80O3Sr0.20Ti0.20
  • Wyckoff Sequence: 161,ba2
  • Z Formula Units: 6
  • Density: ρ = 7.62 Mg·m−3
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Crystallographic Data

Cell Parameters

Published Data
Standardized Data
Unit Cell
Niggli-Reduced Cell
Space Group
a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation
Co-ord. No.
Atomic Env.

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Displacement Parameters

Isotropic

Site
Published
B [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1639151

  • Copyright

    ©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

  • Chief Editor

    Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

    villars.mpds@bluewin.ch

  • Credits

    SpringerMaterials Release 2016.

    Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS

    All Rights Reserved. Version 2016.10.

    Project Coordinator: Shuichi Iwata

    Section-Editor: Karin Cenzual (Crystal Structures)

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